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Name |
2-Pyridinecarboxamide,N-(2-aminoethyl)-5-chloro- |
EINECS | N/A |
CAS No. | 103878-84-8 | Density | 1.286 g/cm3 |
PSA | 68.01000 | LogP | 1.51470 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H10ClN3O | Boiling Point | 397.4 °C at 760 mmHg |
Molecular Weight | 199.64 | Flash Point | 194.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26 | Risk Codes | 22-36 |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
Lazabemide;N-(2-Aminoethyl)-5-chloro-2-pyridinecarboxamide;Ro 19-6327/000; |
Article Data | 4 |
The 2-Pyridinecarboxamide,N-(2-aminoethyl)-5-chloro- is an organic compound with the formula C8H10ClN3O. The IUPAC name of this chemical is N-(2-Aminoethyl)-5-chloropyridine-2-carboxamide. With the CAS registry number 103878-84-8, it is also named as 5-Chloro-pyridine-2-carboxylic acid (2-amino-ethyl)-amide. Besides, its molecular weight is 199.64. It can be used as Anti-Parkinson drugs and Monoamine oxidase inhibitors.
The physical properties of 2-Pyridinecarboxamide,N-(2-aminoethyl)-5-chloro- are: (1)ACD/LogP: -0.42; (2)ACD/LogD (pH 5.5): -3.21; (3)ACD/LogD (pH 7.4): -1.62; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 36.44 Å2; (12)Index of Refraction: 1.571; (13)Molar Refractivity: 51.03 cm3; (14)Molar Volume: 155.1 cm3; (15)Polarizability: 20.22×10-24 cm3; (16)Surface Tension: 53.3 dyne/cm; (17)Density: 1.286 g/cm3; (18)Flash Point: 194.2 °C; (19)Enthalpy of Vaporization: 64.79 kJ/mol; (20)Boiling Point: 397.4 °C at 760 mmHg; (21)Vapour Pressure: 1.59E-06 mmHg at 25 °C.
Preparation: this chemical can be prepared by 5-Chloropyridine-2-carboxylic acid and N-(2-Aminoethyl) amino acid tert-butyl.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cnc(C(=O)NCCN)cc1
(2)InChI: InChI=1/C8H10ClN3O/c9-6-1-2-7(12-5-6)8(13)11-4-3-10/h1-2,5H,3-4,10H2,(H,11,13)
(3)InChIKey: JZXRLKWWVNUZRB-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C8H10ClN3O/c9-6-1-2-7(12-5-6)8(13)11-4-3-10/h1-2,5H,3-4,10H2,(H,11,13)
(5)Std. InChIKey: JZXRLKWWVNUZRB-UHFFFAOYSA-N